SpectraBase Spectrum ID |
Kc4tD9kMvG0 |
Name |
(3S)-6-Benzenesulfonyl-3-methylhexanoic acid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C13H18O4S |
InChI |
InChI=1S/C13H18O4S/c1-11(10-13(14)15)6-5-9-18(16,17)12-7-3-2-4-8-12/h2-4,7-8,11H,5-6,9-10H2,1H3,(H,14,15)/t11-/m0/s1 |
InChIKey |
IDNCGIQZQNPIJX-NSHDSACASA-N |
Literature Reference DOI |
10.1002/cjoc.200790252 |
Molecular Weight |
270.343 g/mol |
SMILES |
OC(C[C@](CCCS(=O)(c1ccccc1)=O)(C)[H])=O |
SPLASH |
splash10-00nf-9300000000-5b120d5e903dbafb092f |
Source of Spectrum |
CJC-25-1361-5 |
Synonyms |
(S)-3-methyl-6-(phenylsulfonyl)hexanoic acid
(3S)-6-(benzenesulfonyl)-3-methylhexanoic acid
(3S)-6-(benzenesulfonyl)-3-methyl-hexanoic acid
(3S)-3-methyl-6-(phenylsulfonyl)hexanoic acid |
Wiley ID |
1772128 |